기본 정보
- 표준 SMILES
C=CC(=O)OCC1CCCO1- InChIKey
YNXCGLKMOXLBOD-UHFFFAOYSA-N- 분자식
- C8H12O3
- 평균 분자량
- 156.18 g/mol
- 단동위원소 질량
- 156.07864424
이름 및 식별자
- 우선 이름
- Tetrahydrofurfuryl acrylate
- IUPAC
- oxolan-2-ylmethyl prop-2-enoate
- 현지명
- 테트라하이드로푸르푸릴 아크릴레이트
- 영어명
- Tetrahydrofurfuryl acrylate
- 분자식
- C8H12O3
- 분자량
- 156.18
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
2399-48-6- PubChem CID
- 94232
- DTXSID
DTXSID8044884- ChEMBL
CHEMBL3187472- UNII
- KC4X335T45
- EC Number
- 219-268-7
- Nikkaji
- J82.100D
물성
구조 계산 물성
- XLogP
- 1.1
- 극성 표면적
- 35.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 153
실험 및 물리화학적 성질
Physical Description
Liquid; Other Solid
Clear liquid with a musty odor.
물리화학적 성질
- 끓는 점
- 87 °C/9 · 87 °C/9 mmHg (lit.)
- 밀도
- 1.064 g/mL · 1.064 g/mL at 25 °C (lit.)
- 증기압
- 1.19 hPa · 1.19hPa at 25℃
- 굴절률
- 20 · n20/D 1.46(lit.)
- 인화점
- 230 °F · >230 °F
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- 물에 용해됨
- 물리적 상태
- 투명한 액체
- 색상
- 무색 내지 거의 무색
- 수용성
- 79.1 g/L · 79.1g/L at 20.9℃
- BRN
- 113115 · 113115
- 화장품 원료 기능
- 점도 조절
- InChI
- 1S/C8H12O3/c1-2-8(9)11-6-7-4-3-5-10-7/h2,7H,1,3-6H2
- InChIKey
- YNXCGLKMOXLBOD-UHFFFAOYSA-N
- SMILES
- C=CC(=O)OCC1CCCO1
- LogP
- 0.81 at · 0.81 at 21.7℃
- EPA
- Tetrahydrofurfuryl acrylate (2399-48-6)
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 3.7% (16 of 434) of reports.
Danger
H302 (47.9%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P318, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 434 reports by companies from 17 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
유해성 정보
Regulatory Information
Chemical: 2-Propenoic acid, (tetrahydro-2-furanyl)methyl ester
2-Propenoic acid, (tetrahydro-2-furanyl)methyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propenoic acid, (tetrahydro-2-furanyl)methyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 01-07-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/20149
2-Propenoic acid, (tetrahydro-2-furanyl)methyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and Categories
Acute Tox. 4 (47.9%)
Acute toxicity (Oral) - Category 4
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- UD3670893
- ridadr
- 3334
- HS 번호
- 29321900
- risk_code
- 36/38
- hazard_code
- Xi
- safety_code
- 26
- 위험 등급
- 9
- 기존화학 물질
- KE-29729
- Hazard Classifications
- Aquatic Chronic 3Eye Irrit. 2Skin Irrit. 2
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
용도 및 제조
General Manufacturing Information
Miscellaneous Manufacturing
2-Propenoic acid, (tetrahydro-2-furanyl)methyl ester: ACTIVE
응용 분야
용도Tetrahydrofurfuryl acrylate may be used as an acrylic matrix for silver nanoparticles/polymer nanocomposites . It can form copolymers with butadiene. Prior to transfer printing, cellulosic and proteinic fibers are grafted with THFA.
용도Tetrahydrofurfuryl acrylate (THFA) can be used to prepare bio-based photopolymers. A series of thermostable shape memory photopolymers were synthesised from a mixture of two bio-based monomers, THFA and tridecyl methacrylate, with the addition of a small amount of 1,3-benzodithiol. Ethyl phenylphosphonate (2,4,6 trimethylbenzoyl) was used as a photoinitiator. The biorenewable carbon content of these photopolymers ranged from (63.7-74.9) %. The increase in THFA content in the photocured resins increased the light curing rate, increased the stiffness, and improved the mechanical and thermal properties of the obtained polymers. The developed bio-based photopolymers could replace petroleum-derived thermostable shape memory polymer analogues in a wide range of applications[1].
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